1-(3-methylbenzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol iodide

Systemtic Name: 1-(3-methylbenzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol iodide Openeye Name: 1-(3-methylbenzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol iodide CAS Name: 1-(3-methyl-1-benzimidazol-3-iumyl)-3-phenoxy-2-propanol iodide IUPAC Name: 1-(3-methylbenzimidazol-3-ium-1-yl)-3-phenoxypropan-2-ol iodide Traditional Name: 1-(3-methylbenzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol iodide Formula: C17H19IN2O2 MolecularWeight: 410.24943

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)CC(COC3=CC=CC=C3)O.[I-]

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)CC(COC3=CC=CC=C3)O.[I-]

InChI

InChI=1S/C17H19N2O2.HI/c1-18-13-19(17-10-6-5-9-16(17)18)11-14(20)12-21-15-7-3-2-4-8-15;/h2-10,13-14,20H,11-12H2,1H3;1H/q+1;/p-1